Consensus flow list

N,n'-(3,3'-dimethyl[1,1'-biphenyl]-4,4'-diyl)bis[2-[(2,4-dichlorophenyl)azo]-3-oxobutyramide]

fo-fd01edd6d0456092

Identity

Type
Neutral molecule
CAS
5979-28-2
EC
227-783-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for N,n'-(3,3'-dimethyl[1,1'-biphenyl]-4,4'-diyl)bis[2-[(2,4-dichlorophenyl)azo]-3-oxobutyramide]

Alternative labels

20

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string JFMYRCRXYIIGBB-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C34H28Cl4N6O4/c1-17-13-21(5-9-27(17)39-33(47)31(19(3)45)43-41-29-11-7-23(35)15-25(29)37)22-6-10-28(18(2)14-22)40-34(48)32(20(4)46)44-42-30-12-8-24(36)16-26(30)38/h5-16,31-32H,1-4H3,(H,39,47)(H,40,48)
IUPAC name chemrof:IUPAC_name N,N′-(3,3′-Dimethyl[1,1′-biphenyl]-4,4′-diyl)bis[2-[2-(2,4-dichlorophenyl)diazenyl]-3-oxobutanamide]
Molecular formula chemrof:molecular_formula C34H28Cl4N6O4
Molecular mass chemrof:molecular_mass 726.448
Monoisotopic mass chemrof:monoisotopic_mass 724.092614
SMILES string chemrof:smiles_string CC(=O)C(N=Nc1ccc(Cl)cc1Cl)C(=O)Nc1ccc(-c2ccc(NC(=O)C(N=Nc3ccc(Cl)cc3Cl)C(C)=O)c(C)c2)cc1C

Known URLs

9

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=5979-28-2 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.025.258 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6021452 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=521238 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/R3896P1A0H enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J35.647F enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/22288 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q126677892 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Pigment_Yellow_16 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
7803fc5f-97ac-4f6b-91ec-5bdfb74afe49 Environmental → Air → Aircraft cruise height EF 3.1 kg 0
e773a511-4002-4d23-82d7-bb28ae3e078c Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 0
9aede8ad-bbe3-453a-af7c-d44383cef3b0 Environmental → Air → Indoor EF 3.1 kg 0
81ef370e-03d6-4900-b0c3-bb8e799c1be9 Environmental → Air → Long-term EF 3.1 kg 0
61e3ecbf-a583-42c6-87a1-5dbef5fcf96e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 0
fe332ea8-852d-47ea-a07f-97093294a9a7 Environmental → Air → Unknown EF 3.1 kg 0
f469a98b-1d9f-4432-8ae9-4b87def91136 Environmental → Ground → Agricultural EF 3.1 kg 0
4d9951b7-fcdb-4397-87d4-97d971f743e2 Environmental → Ground → Non-agricultural EF 3.1 kg 0
8facf22c-7c47-4b36-bf3b-300af9fb29c5 Environmental → Ground → Unknown EF 3.1 kg 0
c61490bf-919c-41f4-8665-ed194347f0d8 Environmental → Water → Long-term EF 3.1 kg 0
8d1e46d2-0369-411a-9aed-256dc617e792 Environmental → Water → Ocean EF 3.1 kg 0
5e99958f-b6aa-411e-80fc-c83c0f9658a3 Environmental → Water → Surface water EF 3.1 kg 0
d51f2a3e-9c4b-4812-bf43-46e4f066636f Environmental → Water → Unknown EF 3.1 kg 0

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-fd01edd6d0456092",
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      "@value": "N,n'-(3,3'-dimethyl[1,1'-biphenyl]-4,4'-diyl)bis[2-[(2,4-dichlorophenyl)azo]-3-oxobutyramide]",
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  "altLabel": [
    {
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    {
      "@value": "Butanamide, N,N′-(3,3′-dimethyl[1,1′-biphenyl]-4,4′-diyl)bis[2-[2-(2,4-dichlorophenyl)diazenyl]-3-oxo-",
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    {
      "@value": "Resamine Fast Yellow 3GL",
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      "@value": "Siloton Yellow NCG",
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      "@value": "Termosolido Yellow GL Supra",
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  "properties": {
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        }
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    "https://w3id.org/chemrof/inchi2d_key_string": {
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      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C34H28Cl4N6O4/c1-17-13-21(5-9-27(17)39-33(47)31(19(3)45)43-41-29-11-7-23(35)15-25(29)37)22-6-10-28(18(2)14-22)40-34(48)32(20(4)46)44-42-30-12-8-24(36)16-26(30)38/h5-16,31-32H,1-4H3,(H,39,47)(H,40,48)"
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